| BioID | bio1050 |
|---|
| Name | CHRYSOSPLENOL C |
|---|
| ChEMBL ID | CHEMBL483031 |
|---|
| Molecular Formula | C18H16O8 |
|---|
| Molecular Weight | 360.32 |
|---|
| Molecular Weight (Monoisotopic) | 360.0845 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Chrysosplenol C |
|---|
| Smiles | COc1cc(-c2oc3cc(OC)c(O)c(O)c3c(=O)c2OC)ccc1O |
|---|
| Inchi | InChI=1S/C18H16O8/c1-23-10-6-8(4-5-9(10)19)17-18(25-3)16(22)13-11(26-17)7-12(24-2)14(20)15(13)21/h4-7,19-21H,1-3H3 |
|---|
| Inchi Key | QQBSPLCHDUCBNM-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 4.0 |
|---|
| Bioactivities | 13.0 |
|---|
| Np Likeness Score | 1.36 |
|---|
| Records Key | ['Chrysosplenol C', 'chrysosplenol C', '17', '7'] |
|---|
| Records Name | [4',5,6-trihydroxy-3,3',7-trimethoxyflavone", 'chrysosplenol C', 'Chrysosplenol C', 'Chrysosplenol C']" |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
